6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine

C26H32N4 — CID 18414414

IUPAC6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
SMILESCC(Cc1ccccc1)N1CCN(CCc2ccc(-c3cccc(N)n3)cc2)CC1
InChIInChI=1S/C26H32N4/c1-21(20-23-6-3-2-4-7-23)30-18-16-29(17-19-30)15-14-22-10-12-24(13-11-22)25-8-5-9-26(27)28-25/h2-13,21H,14-20H2,1H3,(H2,27,28)
InChIKeyPAPMUDRLRHHZPU-UHFFFAOYSA-N
MW400.57 g/mol
LogP4.12
Rot. Bonds7

About 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine

6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine (PubChem CID 18414414) has the molecular formula C26H32N4 and a molecular weight of 400.57 g/mol. Its IUPAC name is 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
PubChem CID18414414
Molecular FormulaC26H32N4
Molecular Weight400.57 g/mol
Exact Mass400.26
IUPAC Name6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
SMILESCC(Cc1ccccc1)N1CCN(CCc2ccc(-c3cccc(N)n3)cc2)CC1
InChIInChI=1S/C26H32N4/c1-21(20-23-6-3-2-4-7-23)30-18-16-29(17-19-30)15-14-22-10-12-24(13-11-22)25-8-5-9-26(27)28-25/h2-13,21H,14-20H2,1H3,(H2,27,28)
InChIKeyPAPMUDRLRHHZPU-UHFFFAOYSA-N
XLogP4.12
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.57
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-[3-[4-(2-phenylethyl)piperazin-1-yl]propyl]phenyl]pyridin-2-amine
CID 18414443
6-[4-[2-(4-phenylpiperazin-1-yl)ethyl]phenyl]pyridin-2-amine
CID 12016074
6-[4-[2-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
CID 18414394
2,4-bis[4-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]piperazin-1-yl]-1,5-bis(4-chlorophenyl)pentan-3-one
CID 151062106
6-[4-[2-(8-azaspiro[4.5]decan-8-yl)ethyl]phenyl]pyridin-2-amine;6-[4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
CID 161043442
2-[4-[2-[4-(6-amino-2-pyridinyl)-2-methylphenyl]ethyl]piperazin-1-yl]-3-phenylpropanal
CID 174462905
3-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]-N-(3-phenylpropyl)-3-azabicyclo[3.1.0]hexan-6-amine
CID 18414455
4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]morpholine
CID 123753899
1-[1-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]pyrrolidin-3-yl]-1-benzylurea
CID 57279783
6-[2-cyclohexyloxy-4-[1-[4-(2-phenylethyl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine
CID 22624295
3-[4-(1-phenylpropan-2-yl)piperazin-1-yl]propanoic acid
CID 65055622
8-[2-[4-(6-amino-2-pyridinyl)phenyl]ethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 18414542

Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine?
The IUPAC name of 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine (CID 18414414) is 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine.
What is the SMILES notation for 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine?
The canonical SMILES for 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine is CC(Cc1ccccc1)N1CCN(CCc2ccc(-c3cccc(N)n3)cc2)CC1.
What is the InChIKey of 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine?
The InChIKey is PAPMUDRLRHHZPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H32N4/c1-21(20-23-6-3-2-4-7-23)30-18-16-29(17-19-30)15-14-22-10-12-24(13-11-22)25-8-5-9-26(27)28-25/h2-13,21H,14-20H2,1H3,(H2,27,28).
What are the key properties of 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine?
6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine has a molecular weight of 400.57 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-[4-(1-phenylpropan-2-yl)piperazin-1-yl]ethyl]phenyl]pyridin-2-amine is sourced from PubChem (CID 18414414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).